N-cyclopropyl-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide

C16H19N3O4 — CID 4881001

IUPACN-cyclopropyl-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCOc1ccc(C2(C)NC(=O)N(CC(=O)NC3CC3)C2=O)cc1
InChIInChI=1S/C16H19N3O4/c1-16(10-3-7-12(23-2)8-4-10)14(21)19(15(22)18-16)9-13(20)17-11-5-6-11/h3-4,7-8,11H,5-6,9H2,1-2H3,(H,17,20)(H,18,22)
InChIKeyPCRSCGAFJJJSIB-UHFFFAOYSA-N
MW317.34 g/mol
LogP0.74
Rot. Bonds5

About N-cyclopropyl-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide

N-cyclopropyl-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide (PubChem CID 4881001) has the molecular formula C16H19N3O4 and a molecular weight of 317.34 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
PubChem CID4881001
Molecular FormulaC16H19N3O4
Molecular Weight317.34 g/mol
Exact Mass317.14
IUPAC NameN-cyclopropyl-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCOc1ccc(C2(C)NC(=O)N(CC(=O)NC3CC3)C2=O)cc1
InChIInChI=1S/C16H19N3O4/c1-16(10-3-7-12(23-2)8-4-10)14(21)19(15(22)18-16)9-13(20)17-11-5-6-11/h3-4,7-8,11H,5-6,9H2,1-2H3,(H,17,20)(H,18,22)
InChIKeyPCRSCGAFJJJSIB-UHFFFAOYSA-N
XLogP0.74
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.34
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide (CID 4881001) is N-cyclopropyl-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide is COc1ccc(C2(C)NC(=O)N(CC(=O)NC3CC3)C2=O)cc1.
What is the InChIKey of N-cyclopropyl-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?
The InChIKey is PCRSCGAFJJJSIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O4/c1-16(10-3-7-12(23-2)8-4-10)14(21)19(15(22)18-16)9-13(20)17-11-5-6-11/h3-4,7-8,11H,5-6,9H2,1-2H3,(H,17,20)(H,18,22).
What are the key properties of N-cyclopropyl-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?
N-cyclopropyl-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide has a molecular weight of 317.34 g/mol, XLogP of 0.74, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide is sourced from PubChem (CID 4881001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).